[(E)-(1-amino-2-chloroethylidene)amino] N-(4-chlorophenyl)carbamate

Formula:C9H9N3O2Cl2 Mutagenic:high Tumorigenic:high Reproductive Effective:high [(E)-(1-amino-2-chloroethylidene)amino] N-(4-chlorophenyl)carbamate is a drug-like molecule.

MolName	[(E)-(1-amino-2-chloroethylidene)amino] N-(4-chlorophenyl)carbamate
MolecularFormula	C9H9N3O2Cl2
Smiles	N/C(/CCl)=N/OC(Nc(cc1)ccc1Cl)=O
InChI	InChI=1S/C9H9Cl2N3O2/c10-5-8(12)14-16-9(15)13-7-3-1-6(11)2-4-7/h1-4H,5H2,(H2,12,14)(H,13,15)
InChIK	LGFFMGOCIIGXSJ-UHFFFAOYSA-N
TotalMolweight	262.095
Molweight	262.095
MonoisotopicMass	261.007181
CLogP	2.4575
CLogS	-4.019
H Acceptors	5
H Donors	2
TotalSurfaceArea	188.56
Relative PSA	0.32499
PolarSurfaceArea	76.71
Druglikeness	-5.8148
Mutagenic	high
Tumorigenic	high
Reproductive Effective	high
Irritant	none
Nasty Functions
Shape Index	0.75
Fragments	1
Non HAtoms	16
NonCHAtoms	7
Electronegative Atoms	7
Rotatable Bond	4
Rings Closures	1
Small Rings	1
Aromatic Rings	1
Aromatic Atoms	6
Sp3Atoms	2
Symmetricatoms	2
Amides	1
StereoCon

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